2368-0649 Screening compound: (2Z,5E)-5-({3-bromo-5-methoxy-4-[(naphthalen-1-yl)methoxy]phenyl}methylidene)-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one

2368-0649 Screening compound: (2Z,5E)-5-({3-bromo-5-methoxy-4-[(naphthalen-1-yl)methoxy]phenyl}methylidene)-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one
2368-0649 Screening compound: (2Z,5E)-5-({3-bromo-5-methoxy-4-[(naphthalen-1-yl)methoxy]phenyl}methylidene)-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 2368-0649
(2Z,5E)-5-({3-bromo-5-methoxy-4-[(naphthalen-1-yl)methoxy]phenyl}methylidene)-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

2368-0649

Molecular Formula

C30H25BrN2O3S (C30 H25 BrN2 O3 S)

Compound Name

(2Z,5E)-5-({3-bromo-5-methoxy-4-[(naphthalen-1-yl)methoxy]phenyl}methylidene)-2-[(3,5-dimethylphenyl)imino]-1,3-thiazolidin-4-one

IUPAC name

(2Z5E)-5-({3-bromo-5-methoxy-4-[(naphthalen-1-yl)methoxy]phenyl}methylidene)-2-[(35-dimethylphenyl)imino]-13-thiazolidin-4-one

SMILES

Cc1cc(/N=C(/NC2=O)\S/C2=C/c(cc2OC)cc(Br)c2OCc2cccc3ccccc23)cc(C)c1

InChI

InChI=1S/C30H25BrN2O3S/c1-18-11-19(2)13-23(12-18)32-30-33-29(34)27(37-30)16-20-14-25(31)28(26(15-20)35-3)36-17-22-9-6-8-21-7-4-5-10-24(21)22/h4-16H,17H2,1-3H3,(H,32,33,34)

InChI Key

XXXPHDCGOCTGGT-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD01610702

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

573.51

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

6.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

7.455

Distribution Coefficient, logD

7.455

Water Solubility, LogSw

-6.74

Polar Surface Area

47.912

Acid Dissociation Constant (pKa)

12.00

Base Dissociation Constant (pKb)

1.59

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

13.30

2368-0649 in Drug Discovery

Included in Screening Libraries

MCL1 Targeted Library (12200 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Digestive system
  • Respiratory tract
  • Male
  • Female
  • Hemic and lymphatic

References: we are preparing a list of scientific research reports with 2368-0649 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 2368-0649?
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What is the minimum amount of 2368-0649 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 2368-0649
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 2368-0649
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 2368-0649 available by request